N-tribenzamidosilylbenzamide

C28H24N4O4Si — CID 175170799

IUPACN-tribenzamidosilylbenzamide
SMILESO=C(N[Si](NC(=O)c1ccccc1)(NC(=O)c1ccccc1)NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C28H24N4O4Si/c33-25(21-13-5-1-6-14-21)29-37(30-26(34)22-15-7-2-8-16-22,31-27(35)23-17-9-3-10-18-23)32-28(36)24-19-11-4-12-20-24/h1-20H,(H,29,33)(H,30,34)(H,31,35)(H,32,36)
InChIKeyHCISVULGPJCVCS-UHFFFAOYSA-N
MW508.61 g/mol
LogP3.14
Rot. Bonds8

About N-tribenzamidosilylbenzamide

N-tribenzamidosilylbenzamide (PubChem CID 175170799) has the molecular formula C28H24N4O4Si and a molecular weight of 508.61 g/mol. Its IUPAC name is N-tribenzamidosilylbenzamide.

Molecular Properties

Compound NameN-tribenzamidosilylbenzamide
PubChem CID175170799
Molecular FormulaC28H24N4O4Si
Molecular Weight508.61 g/mol
Exact Mass508.16
IUPAC NameN-tribenzamidosilylbenzamide
SMILESO=C(N[Si](NC(=O)c1ccccc1)(NC(=O)c1ccccc1)NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C28H24N4O4Si/c33-25(21-13-5-1-6-14-21)29-37(30-26(34)22-15-7-2-8-16-22,31-27(35)23-17-9-3-10-18-23)32-28(36)24-19-11-4-12-20-24/h1-20H,(H,29,33)(H,30,34)(H,31,35)(H,32,36)
InChIKeyHCISVULGPJCVCS-UHFFFAOYSA-N
XLogP3.14
TPSA116.40 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500508.61
LogP ≤ 53.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-tribenzamidosilylbenzamide?
The IUPAC name of N-tribenzamidosilylbenzamide (CID 175170799) is N-tribenzamidosilylbenzamide.
What is the SMILES notation for N-tribenzamidosilylbenzamide?
The canonical SMILES for N-tribenzamidosilylbenzamide is O=C(N[Si](NC(=O)c1ccccc1)(NC(=O)c1ccccc1)NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-tribenzamidosilylbenzamide?
The InChIKey is HCISVULGPJCVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N4O4Si/c33-25(21-13-5-1-6-14-21)29-37(30-26(34)22-15-7-2-8-16-22,31-27(35)23-17-9-3-10-18-23)32-28(36)24-19-11-4-12-20-24/h1-20H,(H,29,33)(H,30,34)(H,31,35)(H,32,36).
What are the key properties of N-tribenzamidosilylbenzamide?
N-tribenzamidosilylbenzamide has a molecular weight of 508.61 g/mol, XLogP of 3.14, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tribenzamidosilylbenzamide is sourced from PubChem (CID 175170799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).